5-amino-1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-1,2-dihydro-3H-pyrrol-3-one
Chemical Structure Depiction of
5-amino-1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-1,2-dihydro-3H-pyrrol-3-one
5-amino-1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-1,2-dihydro-3H-pyrrol-3-one
Compound characteristics
| Compound ID: | Y043-8799 |
| Compound Name: | 5-amino-1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-1,2-dihydro-3H-pyrrol-3-one |
| Molecular Weight: | 470.34 |
| Molecular Formula: | C21 H16 Br N3 O3 S |
| Smiles: | C1C(C(=C(N)N1Cc1ccc2c(c1)OCO2)c1nc(cs1)c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.7024 |
| logD: | 4.7024 |
| logSw: | -4.9338 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.994 |
| InChI Key: | QFVWPLDQCNOUDT-UHFFFAOYSA-N |